N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-cyano-benzamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-cyano-benzamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-cyano-benzamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-4-cyanobenzamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-cyanobenzamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-cyano-benzamide Formula: C20H22ClN4O+ MolecularWeight: 369.86788

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H21ClN4O/c1-2-24-9-11-25(12-10-24)19-8-7-17(21)13-18(19)23-20(26)16-5-3-15(14-22)4-6-16/h3-8,13H,2,9-12H2,1H3,(H,23,26)/p+1